Chemical Properties of Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester

Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester

InChI
InChI=1S/C15H18ClNO3/c1-3-4-11(2)20-15(19)10-9-14(18)17-13-7-5-12(16)6-8-13/h5-11H,3-4H2,1-2H3,(H,17,18)/b10-9+
InChI Key
NAMGGIHOZXIRHQ-MDZDMXLPSA-N
Formula
C15H18ClNO3
SMILES
CCCC(C)OC(=O)C=CC(=O)Nc1ccc(Cl)cc1
Molecular Weight1
295.76
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Physical Properties

Property Value Unit Source
ΔfusH° 40.20 kJ/mol Joback Calculated Property
logPoct/wat 3.566 Crippen Calculated Property
McVol 225.380 ml/mol McGowan Calculated Property
Inp [2577.00; 2577.00]   Show Hide
Inp 2577.00 NIST
Inp 2577.00 NIST
Tfus 349.23 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [617.98; 682.71] J/mol×K [777.87; 994.83] Show Hide
Cp,gas 617.98 J/mol×K 777.87 Joback Calculated Property
Cp,gas 631.15 J/mol×K 814.03 Joback Calculated Property
Cp,gas 643.30 J/mol×K 850.19 Joback Calculated Property
Cp,gas 654.49 J/mol×K 886.35 Joback Calculated Property
Cp,gas 664.75 J/mol×K 922.51 Joback Calculated Property
Cp,gas 674.14 J/mol×K 958.67 Joback Calculated Property
Cp,gas 682.71 J/mol×K 994.83 Joback Calculated Property

Similar Compounds

Fumaric acid, monoamide, N-(4-phenoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-pentyl ester. Fumaric acid, monoamide, N-methyl-N-phenyl-, 2-pentyl ester. Fumaric acid, monoamide, N-(2-bromophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-fluorophenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester. Fumaric acid, monoamide, N-(4-chlorophenyl)-, isopropyl ester. Tetrazepam M (hydroxy-), isomer 3, hydrolysis, acetylated. Tetrazepam M (hydroxy-), isomer 2, hydrolysis, acetylated. Tetrazepam M (hydroxy-), isomer 4, hydrolysis, acetylated.

Find more compounds similar to Fumaric acid, monoamide, N-(4-chlorophenyl)-, 2-pentyl ester.

Sources

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